SCHEMBL7956544

SCHEMBL7956544

CCCCOc1ccccc1NC(C)=O

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.72
LMNA P02545 3/20 0.68
SMN1; SMN2 Q16637 1/20 0.68
BRD4 O60885 1/20 0.63
POLB P06746 2/20 0.63
TSHR P16473 1/20 0.63
HSD17B10 Q99714 1/20 0.57
RAB9A P51151 2/20 0.57
NPC1 O15118 1/20 0.57
MAPT P10636 3/20 0.55
GAA P10253 2/20 0.55
ALDH1A1 P00352 2/20 0.55
PKM P14618 1/20 0.55
HTT P42858 1/20 0.55
NLRP1 Q9C000 1/20 0.55
KDM4E B2RXH2 2/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
MEN1 O00255 1/20 0.53
ALOX15 P16050 1/20 0.53
MAPK1 P28482 1/20 0.53

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL248401 0.95 KMT2A (0.66) KMT2ALMNASMN1; SMN2BRD4POLB
SCHEMBL7952997 0.94 KMT2A (0.64) KMT2ALMNASMN1; SMN2BRD4POLB
SCHEMBL11482525 0.94 KMT2A (0.64) KMT2ALMNASMN1; SMN2BRD4POLB
SCHEMBL14625066 0.94 KMT2A (0.64) KMT2ALMNASMN1; SMN2BRD4POLB
SCHEMBL7959649 0.92 RAB9A (0.67) KMT2ALMNASMN1; SMN2BRD4POLB
SCHEMBL9570553 0.90 LMNA (0.67) KMT2ALMNASMN1; SMN2BRD4POLB
SCHEMBL9570675 0.90 LMNA (0.67) KMT2ALMNASMN1; SMN2BRD4POLB
SCHEMBL11546122 0.90 LMNA (0.75) KMT2ALMNASMN1; SMN2BRD4POLB
SCHEMBL6838359 0.87 KMT2A (0.68) KMT2ALMNASMN1; SMN2POLBTSHR
SCHEMBL1545262 0.87 LMNA (0.63) KMT2ALMNASMN1; SMN2BRD4POLB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6245779-B1 ANALGESICS; ANTIINFLAMMATORY AGENTS OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 2001-06-12 US disclosed
EP-0997463-A1 NAPHTHYRIDINE DERIVATIVES OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 2000-05-03 EP disclosed
US-5075325-A Cardiovascular disorders SYNTHELABO (FR) 1991-12-24 US disclosed
US-5001159-A Hypotensive, antiulcer, antiischemic agents; migraines, asthma epilepsy, anticoagulants; cardiovasculat disorders SYNTHELABO (FR) 1991-03-19 US disclosed
EP-0292911-A2 Process for the preparation of pure nitro-aminobenzene-compounds HOECHST AKTIENGESELLSCHAFT (DE) 1988-11-30 EP disclosed